File name: Pandora159s1_Wakkerstroom_20211204_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T034030.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20211204_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20211204 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 77: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 79: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 80: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20211204T040446.1Z 8008.169978 65 1 48.65 2 76.80 108.46 75.55 107.95 0.00 1 0.00 1 0 25 2.396e-01 3.022e-02 2.110e-01 8.251e-03 4.681509e-01 4.313143e-03 4.852843e-03 -6.000000e+00 1.379689e-01 228.03 -2.00 3.06 -2.00 320.59 0.00e+00 6.080965e-04 1.669285e-03 1.708757e-03 -6.000000e+00 6.408202e-03 280.71 -2.00 20.00 -2.00 319.99 0.00e+00 4.273 0.000 302.00 328.00 3 4.4967e+00 1.3313e-02 4.1506e-02 -6.0000e+00 3.4418e-01 -1.1987e-01 1.6827e-02 2.4229e-02 -6.0000e+00 3.7456e-01 6.2987e-02 1.5815e-02 1.1615e-02 -6.0000e+00 2.2061e-01 -1.3993e-02 7.9548e-03 3.1865e-03 -6.0000e+00 9.3120e-02 1.1139e-04 1.6028e-04 2.4887e-04 4.2397e-05 -6.0000e+00 6.5574e-03 -1.8227e-03 12 8 8 10 0 0 99.58 19.25 0.47 -0.00182 -0.00062 16 3 1 8 0 3040.280 15.00 19.25 21.16 21.58 21.48 18.7 896.97 100054 -85373 -13877 37034 900000 -79532 900000 -112514 900000 -90096 -81381 900000 -22327 -39251 8936 30757 -6046 77875 -30977 -15022 -9820 49593 -38838 7011 30244 64779 12223 6462 -4455 6991 34569 -10292 16177 -18622 2815 -9220 8131 8872 2809 -5777 -4538 -8908 6256 164 -827 -267 -9510 9021 -4597 1354 -2020 -848 5490 -1461 8669 -967 -2947 -879 748 3263 4437 1316 6180 -38 1075 2234 -3362 -965 -635 1489 -1281 1399 -1270 1305 -2561 1078 -3113 4234 4497 -1039 151 2098 -1458 -2096 145 300 2830 834 1852 456 1590 -196 2283 3112 4266 2198 1515 765 -1452 -1396 -527 -351 1950 1376 567 2058 -20845 971 2065 289 367 222 1373 -755 -64 -31 1355 1017 422 -1346 338 1437 1143 2044 2311 1760 2015 3319 662 1587 -72 -135 -1219 -562 84 -678 87 34 -426 -1278 -359 -481 1312 804 -1361 -117 298 900000 -1122 900000 -2763 900000 -2182 -1875 900000 -386 -980 169 545 -167 1046 -1267 -557 -358 1034 -1990 253 950 1538 487 263 -196 287 1236 -653 896 -1516 179 -655 542 703 289 -765 -661 -1449 918 26 -135 -44 -1730 1387 -828 241 -406 -186 1230 -378 2131 -273 -869 -255 210 885 1235 415 2068 -15 427 840 -1282 -364 -263 690 -672 743 -692 663 -1248 459 -1276 1603 1857 -524 87 1324 -1029 -1574 115 252 2457 758 1672 402 1300 -151 1624 2211 3285 1947 1531 873 -1808 -1732 -608 -369 1886 1369 614 2333 -30713 1229 2783 432 591 371 2225 -1189 -93 -43 1877 1482 659 -2241 556 2287 1773 3041 3296 2426 2661 4439 994 2597 -128 -251 -2354 -1130 178 -1522 197 79 -993 -2933 -778 -995 2620 SS 20211204T043914.7Z 8008.193920 79 1 49.83 2 69.47 105.17 68.44 104.95 0.00 1 0.00 1 0 25 7.734e-02 8.252e-03 5.974e-02 7.035e-03 3.453924e-01 3.544069e-03 3.605833e-03 -6.000000e+00 4.395950e-02 228.03 -2.00 3.06 -2.00 319.13 0.00e+00 2.019218e-03 8.377125e-04 2.510952e-04 -6.000000e+00 1.930892e-03 280.71 -2.00 20.00 -2.00 318.44 0.00e+00 2.824 0.000 302.00 328.00 3 5.4340e+00 9.8324e-03 2.7874e-02 -6.0000e+00 1.0938e-01 5.7583e-02 1.1340e-02 1.6124e-02 -6.0000e+00 1.1885e-01 -1.9323e-02 8.0678e-03 7.7994e-03 -6.0000e+00 7.0697e-02 1.8822e-03 4.2243e-03 2.8580e-03 -6.0000e+00 2.9964e-02 1.4607e-04 -9.4512e-04 2.0659e-04 2.7940e-05 -6.0000e+00 2.0678e-03 -1.3969e-03 11 8 0 10 0 0 99.84 19.24 0.50 -0.00140 -0.00850 16 3 1 8 0 3113.660 15.00 19.24 22.12 21.58 21.48 18.7 901.89 55102 -16539 2479 1052 -19 5885 -23101 -16821 -21045 -15533 12631 36977 -5966 28337 -3620 -15667 -1681 8312 3159 -694 -3028 -1672 322 -7420 5913 -476 7750 2939 3538 37 6016 8584 -1377 829 1220 10920 -5422 758 -963 379 -1174 -2440 -1638 1024 -2355 -183 1136 -465 212 -2813 -45 1070 2619 -1972 715 -1997 2329 1138 -264 475 1865 -206 1190 734 -669 3702 428 702 2759 -1471 -108 1434 -1234 -1168 -1373 -482 1465 482 1550 -1707 387 17 -2287 -1442 -737 -1054 -582 609 102 1248 -329 930 884 2807 850 -377 689 401 -177 -35 -455 -1223 -279 -578 -426 -475 -65 -391 178 -72 -158 124 -222 84 74 1092 466 834 -854 -102 -999 103 -634 513 778 -256 1027 716 165 -388 331 143 382 384 515 -57 -242 -281 -238 -423 -540 155 400 1225 -814 105 43 -1 198 -1086 -838 -1212 -892 553 1348 -380 1537 -311 -1700 -170 802 337 -80 -365 -198 38 -1006 748 -66 997 377 431 5 785 1219 -236 144 200 1592 -1008 156 -241 109 -376 -835 -577 356 -851 -65 397 -163 73 -1024 -17 433 1114 -928 339 -998 1135 558 -129 228 912 -111 695 464 -433 2156 241 388 1609 -1014 -80 1092 -961 -874 -958 -302 816 262 884 -1143 287 14 -2058 -1350 -731 -1119 -649 692 116 1362 -340 875 769 2357 775 -387 781 504 -238 -47 -573 -1425 -303 -646 -513 -606 -86 -545 260 -113 -264 211 -369 131 108 1486 635 1183 -1305 -164 -1644 165 -999 771 1114 -356 1341 944 236 -603 540 242 657 686 972 -113 -493 -583 -496 -865 -1063 290 732 SS 20211204T044551.9Z 8008.198517 82 1 49.51 2 68.05 104.56 67.07 104.39 0.00 1 0.00 1 0 17 3.137e-02 7.005e-03 2.092e-02 3.142e-03 3.248285e-01 1.574458e-03 3.400299e-03 -6.000000e+00 1.783400e-02 228.03 -2.00 3.06 -2.00 318.83 0.00e+00 1.664541e-03 3.410358e-04 2.447201e-04 -6.000000e+00 7.833161e-04 280.71 -2.00 20.00 -2.00 318.13 0.00e+00 2.653 0.000 302.00 328.00 3 4.6748e+00 4.3137e-03 2.6179e-02 -6.0000e+00 4.4375e-02 1.3409e-02 4.9450e-03 1.5107e-02 -6.0000e+00 4.8217e-02 -3.0688e-03 3.3980e-03 7.3053e-03 -6.0000e+00 2.8680e-02 -4.1682e-03 1.7734e-03 2.5745e-03 -6.0000e+00 1.2157e-02 3.7583e-04 -6.1196e-04 9.1982e-05 2.5463e-05 -6.0000e+00 8.3880e-04 -1.9873e-03 11 8 0 10 0 0 87.30 19.24 0.27 -0.00199 -0.00659 26 6 1 8 0 1904.060 14.99 19.24 22.43 21.48 21.48 18.8 903.51 -8561 -2517 3113 -2733 14176 -8063 -5340 -13532 -12149 5429 -16436 3768 -6037 -5987 -2826 -1551 1375 566 2450 501 -1996 -2238 -2964 3581 4485 -4360 853 -3558 3098 1462 3382 1258 961 -4399 -2005 -437 134 1642 -1590 -141 -2738 401 -695 -753 -669 -708 -17 -855 -494 1683 1036 615 1359 482 1040 1868 919 255 406 879 501 1273 1358 428 -973 730 713 1382 1734 409 263 140 -735 237 -83 -118 -101 410 1385 -100 173 -1269 -2722 -1441 -1170 -441 -99 -817 303 -179 433 164 1093 2098 1123 647 783 420 -988 -426 -348 -92 577 448 -1198 -904 -572 -909 -201 -8 115 -138 -227 170 108 991 663 479 -221 -454 -893 80 -214 -51 985 567 1165 1585 751 496 -180 190 162 315 -227 -465 44 -161 -350 -53 203 -495 -194 -415 -128 154 -135 540 -365 -250 -774 -760 301 -1126 223 -450 -525 -280 -169 155 67 302 65 -274 -305 -418 501 660 -725 135 -557 434 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